name total energy Backbone Hbon Sidechain Hbond Van der Waals Electrostatics Solvation Polar Solvation Hydrophobic Van de Waals clashes entropy side chain entropy main chain sloop_entropy mloop_entropy cis_bond torsional clash backbone clash helix dipole water bridge disulfide electrostatic Kon partial covalent bonds PEX13_1N5Z-12_1.PDB -15.55000 -53.33000 -21.90000 -76.57000 -5.76000 99.14000 -97.03000 3.49000 44.10000 95.14000 0.00000 0.00000 0.00000 3.73000 22.85000 0.00000 -2.58000 0.00000 -3.99000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_2.PDB -18.18000 -55.09000 -23.65000 -77.03000 -5.32000 99.58000 -97.70000 3.83000 45.05000 95.25000 0.00000 0.00000 0.00000 3.44000 22.92000 0.00000 -3.02000 0.00000 -3.52000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_3.PDB -15.55000 -54.08000 -21.79000 -76.46000 -3.85000 98.61000 -97.60000 3.59000 44.13000 95.42000 0.00000 0.00000 0.00000 2.87000 22.71000 0.00000 -2.88000 0.00000 -3.50000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_4.PDB -16.91000 -55.09000 -23.75000 -76.99000 -5.69000 100.20000 -97.22000 3.47000 44.57000 95.44000 0.00000 0.00000 0.00000 4.89000 22.94000 0.00000 -2.89000 0.00000 -3.84000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_5.PDB -16.48000 -54.18000 -22.43000 -76.92000 -4.21000 99.20000 -97.93000 3.79000 44.55000 95.22000 0.00000 0.00000 0.00000 2.88000 22.86000 0.00000 -3.31000 0.00000 -3.15000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_6.PDB -18.28000 -54.19000 -24.48000 -76.57000 -5.25000 99.21000 -97.24000 3.39000 44.83000 95.27000 0.00000 0.00000 0.00000 3.52000 22.80000 0.00000 -3.39000 0.00000 -3.37000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_7.PDB -17.26000 -54.30000 -23.85000 -76.96000 -4.88000 99.45000 -97.86000 3.87000 45.32000 95.17000 0.00000 0.00000 0.00000 3.11000 22.84000 0.00000 -2.92000 0.00000 -3.40000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_8.PDB -17.13000 -55.99000 -25.79000 -77.84000 -5.51000 102.34000 -97.82000 3.71000 46.11000 95.99000 0.00000 0.00000 0.00000 3.97000 22.99000 0.00000 -2.99000 0.00000 -3.32000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_9.PDB -15.08000 -54.21000 -21.92000 -75.79000 -3.92000 97.61000 -96.78000 3.80000 43.66000 95.37000 0.00000 0.00000 0.00000 3.38000 22.68000 0.00000 -2.91000 0.00000 -3.37000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_10.PDB -16.12000 -52.98000 -23.06000 -75.70000 -4.97000 96.75000 -96.92000 3.45000 45.28000 95.35000 0.00000 0.00000 0.00000 2.67000 22.92000 0.00000 -2.39000 0.00000 -3.60000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_11.PDB -16.97000 -55.08000 -23.32000 -76.86000 -4.53000 99.04000 -97.71000 3.69000 45.20000 95.44000 0.00000 0.00000 0.00000 3.60000 22.87000 0.00000 -2.98000 0.00000 -3.45000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_12.PDB -17.71000 -55.13000 -23.89000 -76.85000 -5.50000 99.48000 -97.45000 3.90000 45.22000 95.23000 0.00000 0.00000 0.00000 3.67000 22.87000 0.00000 -2.84000 0.00000 -3.55000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_13.PDB -17.92000 -55.05000 -25.22000 -76.73000 -4.85000 99.40000 -97.30000 3.39000 45.82000 95.55000 0.00000 0.00000 0.00000 3.14000 22.82000 0.00000 -2.92000 0.00000 -3.16000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_14.PDB -13.27000 -52.32000 -22.58000 -77.05000 -4.21000 98.31000 -97.31000 3.62000 45.08000 95.51000 0.00000 0.00000 0.00000 3.26000 23.03000 0.00000 -2.57000 0.00000 -3.02000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_15.PDB -17.74000 -53.82000 -22.53000 -75.90000 -4.58000 95.83000 -96.94000 3.29000 44.50000 94.36000 0.00000 0.00000 0.00000 3.35000 22.62000 0.00000 -2.51000 0.00000 -2.78000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_16.PDB -17.51000 -54.97000 -23.32000 -77.05000 -5.10000 99.52000 -97.76000 3.88000 45.01000 95.32000 0.00000 0.00000 0.00000 3.72000 22.86000 0.00000 -2.88000 0.00000 -3.86000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_17.PDB -16.63000 -54.25000 -24.44000 -76.78000 -5.44000 99.62000 -97.26000 3.99000 46.00000 95.16000 0.00000 0.00000 0.00000 2.69000 22.79000 0.00000 -2.51000 0.00000 -3.41000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_18.PDB -17.54000 -53.07000 -21.72000 -75.68000 -4.56000 95.51000 -96.91000 3.37000 43.39000 94.19000 0.00000 0.00000 0.00000 3.18000 22.60000 0.00000 -2.62000 0.00000 -2.62000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_19.PDB -17.40000 -55.00000 -25.31000 -77.05000 -5.44000 100.25000 -97.53000 3.48000 45.78000 95.30000 0.00000 0.00000 0.00000 4.12000 22.88000 0.00000 -2.81000 0.00000 -3.18000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_20.PDB -17.08000 -55.09000 -23.73000 -76.90000 -5.59000 100.00000 -97.35000 3.81000 45.34000 95.52000 0.00000 0.00000 0.00000 3.61000 22.91000 0.00000 -2.81000 0.00000 -3.90000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_21.PDB -14.16000 -52.81000 -21.15000 -76.21000 -3.63000 96.90000 -97.67000 3.66000 43.98000 95.60000 0.00000 0.00000 0.00000 2.79000 23.08000 0.00000 -2.47000 0.00000 -3.16000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_22.PDB -14.73000 -54.16000 -21.15000 -76.26000 -3.86000 98.23000 -97.23000 3.54000 42.91000 95.56000 0.00000 0.00000 0.00000 3.92000 22.81000 0.00000 -2.99000 0.00000 -3.24000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_23.PDB -15.72000 -52.95000 -24.88000 -75.74000 -5.29000 96.98000 -96.45000 3.46000 46.26000 95.38000 0.00000 0.00000 0.00000 2.90000 22.69000 0.00000 -2.25000 0.00000 -3.15000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_24.PDB -15.07000 -53.04000 -22.98000 -76.13000 -5.02000 96.93000 -97.50000 4.66000 45.61000 95.18000 0.00000 0.00000 0.00000 2.78000 23.03000 0.00000 -2.06000 0.00000 -3.50000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_25.PDB -14.67000 -52.98000 -19.90000 -75.53000 -3.45000 94.95000 -96.85000 3.63000 42.56000 94.36000 0.00000 0.00000 0.00000 3.18000 22.63000 0.00000 -2.19000 0.00000 -2.45000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_26.PDB -16.85000 -53.66000 -22.52000 -76.15000 -4.39000 96.17000 -97.38000 3.40000 44.78000 94.60000 0.00000 0.00000 0.00000 3.49000 22.66000 0.00000 -2.41000 0.00000 -2.76000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_27.PDB -16.72000 -54.32000 -25.32000 -76.41000 -5.41000 100.00000 -96.76000 3.59000 45.55000 95.39000 0.00000 0.00000 0.00000 3.27000 22.80000 0.00000 -2.82000 0.00000 -3.47000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_28.PDB -14.04000 -52.29000 -20.51000 -75.36000 -4.04000 95.61000 -96.88000 3.82000 43.07000 95.17000 0.00000 0.00000 0.00000 2.73000 22.79000 0.00000 -2.52000 0.00000 -2.83000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_29.PDB -15.98000 -54.07000 -23.31000 -76.89000 -3.84000 99.79000 -97.64000 3.41000 44.60000 95.56000 0.00000 0.00000 0.00000 2.84000 22.84000 0.00000 -3.18000 0.00000 -3.26000 0.00000 0.00000 70.00000 PEX13_1N5Z-12_30.PDB -14.18000 -53.46000 -23.52000 -76.40000 -4.64000 99.23000 -97.00000 3.93000 43.67000 95.39000 0.00000 0.00000 0.00000 3.82000 22.83000 0.00000 -2.38000 0.00000 -2.81000 0.00000 0.00000 70.00000